#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dxd s VAL 1 N nan 4.87 0.32 0.00 0.11 -1.26 -4.83 120.40 nan 1dxd s VAL 1 Ca nan 1.93 -0.21 0.00 -2.93 0.00 0.00 61.98 nan 1dxd s VAL 1 Cb nan -4.26 -0.10 0.00 -1.53 0.00 0.00 36.38 nan 1dxd s VAL 1 CO nan 0.11 0.85 -0.76 -3.33 0.00 0.00 175.10 nan 1dxd s LEU 2 N 1.42 4.20 0.68 2.54 1.02 -1.26 -5.05 118.68 122.23 1dxd s LEU 2 Ca 0.48 1.60 -0.11 0.00 0.02 0.00 0.00 54.13 56.11 1dxd s LEU 2 Cb -0.19 -4.03 -0.00 0.00 0.02 0.00 0.00 46.19 41.99 1dxd s LEU 2 CO 0.22 -0.13 1.06 -0.94 0.02 0.00 0.00 176.35 176.58 1dxd s SER 3 N -1.86 5.62 0.21 2.29 1.04 -1.26 -4.90 113.70 114.85 1dxd s SER 3 Ca 0.52 1.35 -0.08 0.00 0.48 0.00 0.00 55.95 58.21 1dxd s SER 3 Cb -0.14 -2.26 0.29 0.00 0.10 0.00 0.00 66.02 64.01 1dxd s SER 3 CO 0.19 -1.25 1.77 -0.08 0.98 0.00 0.00 173.24 174.86 1dxd h GLU 4 N -0.59 0.54 -0.83 4.02 4.57 -1.99 -0.54 114.58 119.76 1dxd h GLU 4 Ca -0.45 -0.03 0.06 0.00 -1.18 0.00 0.00 59.36 57.76 1dxd h GLU 4 Cb 1.22 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 29.63 1dxd h GLU 4 CO 0.61 0.36 0.51 0.78 -1.18 0.00 0.00 179.01 180.09 1dxd h GLY 5 N 0.56 1.25 0.93 1.92 0.00 -1.99 0.17 103.07 105.90 1dxd h GLY 5 Ca 0.32 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.25 1dxd h GLY 5 CO -0.26 0.26 0.11 0.83 0.00 0.00 0.00 176.54 177.49 1dxd h GLU 6 N 0.94 0.57 -0.63 4.80 5.08 -1.76 -1.83 114.58 121.75 1dxd h GLU 6 Ca 0.36 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.63 1dxd h GLU 6 Cb 0.16 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 1dxd h GLU 6 CO -0.17 0.59 0.39 -1.49 -1.00 0.00 0.00 179.01 177.33 1dxd h TRP 7 N 0.45 0.72 -0.36 4.33 4.06 -0.70 -1.58 115.95 122.86 1dxd h TRP 7 Ca 0.12 0.02 -0.03 0.00 2.06 0.00 0.00 58.89 61.06 1dxd h TRP 7 Cb 0.26 -0.23 -0.02 0.00 -1.00 0.00 0.00 29.16 28.16 1dxd h TRP 7 CO 0.01 0.41 0.09 1.96 -3.56 0.00 0.00 178.44 177.35 1dxd h GLN 8 N 0.76 0.53 -0.50 0.49 1.08 -0.63 0.33 115.11 117.17 1dxd h GLN 8 Ca 0.26 -0.08 -0.09 0.00 -1.45 0.00 0.00 58.65 57.28 1dxd h GLN 8 Cb 0.03 -0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 27.35 1dxd h GLN 8 CO -0.11 0.49 -0.05 -0.07 -0.95 0.00 0.00 178.83 178.13 1dxd h LEU 9 N 0.52 0.85 0.05 1.46 3.38 -0.47 0.20 115.31 121.31 1dxd h LEU 9 Ca 0.12 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.85 1dxd h LEU 9 Cb 0.19 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.72 1dxd h LEU 9 CO -0.00 0.95 -0.02 0.58 0.09 0.00 0.00 178.44 180.03 1dxd h VAL 10 N 0.80 0.95 -0.07 1.22 2.07 -0.85 -3.01 116.25 117.35 1dxd h VAL 10 Ca 0.14 -0.00 -0.14 0.00 0.82 0.00 0.00 66.70 67.52 1dxd h VAL 10 Cb 0.55 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.26 1dxd h VAL 10 CO 0.03 0.00 -0.57 -0.07 0.02 0.00 0.00 177.57 176.98 1dxd h LEU 11 N -0.07 0.23 -1.06 2.57 3.38 -0.71 -1.97 115.31 117.68 1dxd h LEU 11 Ca -0.01 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1dxd h LEU 11 Cb 0.05 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.72 1dxd h LEU 11 CO 0.01 0.75 -0.46 0.45 0.09 0.00 0.00 178.44 179.28 1dxd h HIS 12 N 0.16 0.02 0.07 1.13 3.86 -0.93 -0.67 115.15 118.79 1dxd h HIS 12 Ca -0.00 -0.01 -0.24 0.00 -1.16 0.00 0.00 60.37 58.96 1dxd h HIS 12 Cb 1.05 -0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.51 1dxd h HIS 12 CO 0.02 0.48 -1.11 -0.24 0.86 0.00 0.00 177.93 177.94 1dxd h VAL 13 N 0.01 1.54 -0.30 2.45 3.04 -1.40 -3.24 116.25 118.35 1dxd h VAL 13 Ca -0.00 -3.02 -0.04 0.00 -1.01 0.00 0.00 66.70 62.63 1dxd h VAL 13 Cb 0.83 2.81 -0.02 0.00 -2.01 0.00 0.00 31.29 32.90 1dxd h VAL 13 CO 0.06 0.88 0.02 -0.25 -1.01 0.00 0.00 177.57 177.27 1dxd h TRP 14 N 0.08 0.46 -0.33 3.17 2.91 -1.09 -0.42 115.95 120.72 1dxd h TRP 14 Ca -0.09 -0.03 0.08 0.00 1.13 0.00 0.00 58.89 59.98 1dxd h TRP 14 Cb 1.82 -0.14 -0.02 0.00 -0.51 0.00 0.00 29.16 30.32 1dxd h TRP 14 CO 0.04 0.44 0.24 0.00 -1.03 0.00 0.00 178.44 178.13 1dxd h ALA 15 N 1.60 2.20 0.15 2.65 0.00 -1.15 -1.09 119.26 123.62 1dxd h ALA 15 Ca 0.10 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.70 1dxd h ALA 15 Cb 0.25 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.07 1dxd h ALA 15 CO 0.00 -0.28 -1.29 0.87 0.00 0.00 0.00 179.25 178.55 1dxd h LYS 16 N 0.09 0.56 -0.71 0.00 1.79 -1.18 -3.14 116.57 113.97 1dxd h LYS 16 Ca 0.16 -0.80 0.11 0.00 -2.18 0.00 0.00 60.65 57.94 1dxd h LYS 16 Cb 0.51 0.28 -0.08 0.00 -1.58 0.00 0.00 32.23 31.35 1dxd h LYS 16 CO -0.01 1.37 0.32 0.28 -1.08 0.00 0.00 179.45 180.32 1dxd h VAL 17 N 0.22 0.77 0.00 0.50 2.07 -1.00 -1.34 116.25 117.47 1dxd h VAL 17 Ca -0.20 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1dxd h VAL 17 Cb 1.97 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 1dxd h VAL 17 CO 0.24 0.09 0.00 -0.62 0.02 0.00 0.00 177.57 177.31 1dxd n GLU 18 N -4.93 0.16 0.23 1.57 1.02 -0.47 -1.46 120.64 116.77 1dxd n GLU 18 Ca 0.12 0.17 0.06 0.00 -0.02 0.00 0.00 57.16 57.49 1dxd n GLU 18 Cb 0.33 -1.50 0.53 0.00 -0.02 0.00 0.00 31.44 30.78 1dxd n GLU 18 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1dxd h ALA 19 N 2.66 1.77 -0.67 0.62 0.00 -1.25 -3.39 119.26 119.00 1dxd h ALA 19 Ca 0.00 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 1dxd h ALA 19 Cb 0.17 -0.02 -0.16 0.00 0.00 0.00 0.00 17.79 17.77 1dxd h ALA 19 CO 0.00 0.18 -0.51 -3.47 0.00 0.00 0.00 179.25 175.45 1dxd n ASP 20 N -4.37 -3.14 -0.11 0.00 2.03 -0.54 -5.02 116.55 105.40 1dxd n ASP 20 Ca -0.03 -3.05 -0.03 0.00 0.52 0.00 0.00 54.79 52.20 1dxd n ASP 20 Cb 0.21 1.70 0.19 0.00 -0.72 0.00 0.00 41.12 42.50 1dxd n ASP 20 CO 0.00 0.00 0.00 1.62 -1.92 0.00 0.00 177.20 176.90 1dxd h VAL 21 N 4.20 1.23 -0.54 5.18 3.04 -1.65 -2.52 116.25 125.18 1dxd h VAL 21 Ca -0.01 -0.88 0.00 0.00 -1.01 0.00 0.00 66.70 64.80 1dxd h VAL 21 Cb 1.07 0.77 -0.03 0.00 -2.01 0.00 0.00 31.29 31.09 1dxd h VAL 21 CO 0.14 0.32 0.36 0.00 -1.01 0.00 0.00 177.57 177.38 1dxd h ALA 22 N 1.32 0.69 -0.52 3.17 0.00 -1.90 0.26 119.26 122.28 1dxd h ALA 22 Ca 0.16 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 1dxd h ALA 22 Cb 0.35 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1dxd h ALA 22 CO 0.01 0.14 -0.03 0.78 0.00 0.00 0.00 179.25 180.15 1dxd h GLY 23 N 0.74 0.97 1.24 0.00 0.00 -1.88 -1.59 103.07 102.54 1dxd h GLY 23 Ca 0.20 -0.69 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 1dxd h GLY 23 CO -0.04 0.64 -0.08 0.45 0.00 0.00 0.00 176.54 177.51 1dxd h HIS 24 N 0.82 0.99 -0.82 5.60 3.86 -1.06 -2.23 115.15 122.31 1dxd h HIS 24 Ca 0.15 -0.18 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1dxd h HIS 24 Cb 0.53 -0.25 -0.04 0.00 1.06 0.00 0.00 27.41 28.70 1dxd h HIS 24 CO 0.03 0.93 0.51 0.78 0.86 0.00 0.00 177.93 181.04 1dxd h GLY 25 N 0.97 1.17 0.97 2.45 0.00 -0.57 -0.74 103.07 107.34 1dxd h GLY 25 Ca 0.14 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 1dxd h GLY 25 CO 0.04 0.46 0.19 1.46 0.00 0.00 0.00 176.54 178.68 1dxd h GLN 26 N 1.12 0.44 -0.73 4.80 4.20 -1.10 -0.62 115.11 123.21 1dxd h GLN 26 Ca 0.30 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.92 1dxd h GLN 26 Cb -0.08 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 27.58 1dxd h GLN 26 CO -0.06 0.34 0.29 -0.44 -0.67 0.00 0.00 178.83 178.29 1dxd h ASP 27 N 0.41 1.00 -0.26 1.46 3.32 -1.01 -0.58 116.42 120.77 1dxd h ASP 27 Ca 0.11 -0.15 -0.06 0.00 0.02 0.00 0.00 57.03 56.96 1dxd h ASP 27 Cb 0.02 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 1dxd h ASP 27 CO -0.02 0.89 -0.06 0.40 -1.72 0.00 0.00 179.24 178.73 1dxd h ILE 28 N 1.06 1.28 -0.37 0.35 2.04 -0.96 -1.14 117.51 119.77 1dxd h ILE 28 Ca 0.25 -1.06 0.00 0.00 1.00 0.00 0.00 64.86 65.04 1dxd h ILE 28 Cb 0.21 1.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.72 1dxd h ILE 28 CO -0.02 0.33 0.23 1.88 0.00 0.00 0.00 178.15 180.57 1dxd h TYR 29 N 0.24 0.48 -0.75 1.37 0.05 -0.92 0.21 116.97 117.64 1dxd h TYR 29 Ca 0.07 0.00 0.02 0.00 0.05 0.00 0.00 58.73 58.87 1dxd h TYR 29 Cb 0.52 -0.16 -0.04 0.00 1.01 0.00 0.00 36.73 38.06 1dxd h TYR 29 CO 0.05 0.32 0.49 0.82 -1.05 0.00 0.00 178.16 178.79 1dxd h ILE 30 N 0.49 1.14 -0.25 -2.88 2.04 -1.00 0.46 117.51 117.51 1dxd h ILE 30 Ca 0.13 -0.33 -0.00 0.00 1.00 0.00 0.00 64.86 65.66 1dxd h ILE 30 Cb -0.02 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.14 1dxd h ILE 30 CO -0.03 0.18 0.15 -0.09 0.00 0.00 0.00 178.15 178.36 1dxd h ARG 31 N 0.96 0.34 -0.10 2.37 9.65 -0.99 -0.96 114.38 125.66 1dxd h ARG 31 Ca 0.29 -0.03 0.01 0.00 -1.10 0.00 0.00 59.98 59.15 1dxd h ARG 31 Cb -0.04 -0.07 -0.01 0.00 -1.39 0.00 0.00 29.97 28.46 1dxd h ARG 31 CO -0.09 0.28 0.03 1.25 2.80 0.00 0.00 179.97 184.24 1dxd h LEU 32 N 0.30 0.03 -0.98 3.80 5.85 -0.49 -0.63 115.31 123.20 1dxd h LEU 32 Ca 0.09 0.01 -0.10 0.00 0.84 0.00 0.00 57.88 58.72 1dxd h LEU 32 Cb 0.03 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1dxd h LEU 32 CO -0.02 0.03 -0.42 -0.26 -0.34 0.00 0.00 178.44 177.44 1dxd h PHE 33 N 0.08 0.22 -0.05 1.25 0.04 -0.81 0.19 116.94 117.86 1dxd h PHE 33 Ca 0.04 -0.06 -0.21 0.00 2.80 0.00 0.00 57.97 60.54 1dxd h PHE 33 Cb 0.03 -0.05 0.01 0.00 2.20 0.00 0.00 35.95 38.14 1dxd h PHE 33 CO -0.10 0.58 -0.78 0.87 -0.60 0.00 0.00 178.31 178.28 1dxd h LYS 34 N 0.16 0.62 -0.05 1.51 6.56 -1.03 -2.91 116.57 121.43 1dxd h LYS 34 Ca 0.01 -0.60 -0.19 0.00 -1.06 0.00 0.00 60.65 58.82 1dxd h LYS 34 Cb 0.81 0.15 -0.01 0.00 -0.57 0.00 0.00 32.23 32.62 1dxd h LYS 34 CO 0.06 1.21 -0.78 0.77 -2.06 0.00 0.00 179.45 178.65 1dxd h SER 35 N 0.25 0.43 -2.26 0.86 0.02 -1.00 -3.39 113.55 108.46 1dxd h SER 35 Ca -0.08 -0.30 -0.58 0.00 -0.84 0.00 0.00 61.79 59.99 1dxd h SER 35 Cb 1.45 -0.13 -0.38 0.00 0.14 0.00 0.00 62.40 63.47 1dxd h SER 35 CO 0.16 1.05 -1.01 1.41 -1.14 0.00 0.00 176.83 177.30 1dxd n HIS 36 N -3.79 -0.65 0.05 3.45 8.25 0.04 -5.00 115.22 117.57 1dxd n HIS 36 Ca -0.04 -3.41 0.20 0.00 -0.26 0.00 0.00 57.72 54.21 1dxd n HIS 36 Cb 0.74 0.05 0.73 0.00 1.12 0.00 0.00 29.99 32.63 1dxd n HIS 36 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1dxd h PRO 37 N 5.09 0.00 0.00 -0.41 0.11 -1.70 -0.73 132.00 134.36 1dxd h PRO 37 Ca 0.20 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.31 1dxd h PRO 37 Cb 0.90 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 1dxd h PRO 37 CO 0.41 0.00 -0.03 1.05 -0.21 0.00 0.00 178.00 179.22 1dxd h GLU 38 N 0.00 0.00 -0.06 1.05 9.09 -1.93 -1.64 114.58 121.10 1dxd h GLU 38 Ca 0.22 0.00 -0.05 0.00 0.05 0.00 0.00 59.36 59.58 1dxd h GLU 38 Cb 0.99 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.08 1dxd h GLU 38 CO -0.00 0.03 -0.20 1.79 0.05 0.00 0.00 179.01 180.68 1dxd h THR 39 N 0.00 1.18 0.00 -1.06 1.35 -1.46 -2.45 112.91 110.46 1dxd h THR 39 Ca -0.00 -0.81 -0.02 0.00 -0.55 0.00 0.00 66.41 65.02 1dxd h THR 39 Cb 0.08 1.36 -0.00 0.00 -1.73 0.00 0.00 68.15 67.85 1dxd h THR 39 CO 0.00 0.24 -0.11 0.25 -0.25 0.00 0.00 175.52 175.65 1dxd h LEU 40 N 0.09 0.00 -1.34 3.87 5.85 -1.46 -2.55 115.31 119.76 1dxd h LEU 40 Ca 0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1dxd h LEU 40 Cb 0.41 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1dxd h LEU 40 CO 0.03 0.11 0.00 -0.33 -0.34 0.00 0.00 178.44 177.91 1dxd h GLU 41 N 0.00 0.00 0.00 1.25 4.39 -1.56 -1.71 114.58 116.96 1dxd h GLU 41 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1dxd h GLU 41 Cb 0.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.90 1dxd h GLU 41 CO 0.01 0.00 0.00 1.63 -1.16 0.00 0.00 179.01 179.49 1dxd n LYS 42 N -2.64 0.22 -3.25 2.33 4.76 -0.96 -4.57 118.16 114.06 1dxd n LYS 42 Ca 0.00 0.22 -0.46 0.00 -2.87 0.00 0.00 58.31 55.21 1dxd n LYS 42 Cb 0.21 -1.78 -0.04 0.00 -1.84 0.00 0.00 35.03 31.58 1dxd n LYS 42 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 1dxd s PHE 43 N -3.12 3.29 0.45 2.13 0.40 -0.64 -4.93 117.98 115.56 1dxd s PHE 43 Ca 0.10 -1.36 0.14 0.00 -0.60 0.00 0.00 56.93 55.22 1dxd s PHE 43 Cb 0.13 -3.88 1.07 0.00 0.51 0.00 0.00 43.02 40.85 1dxd s PHE 43 CO 0.56 -1.10 2.02 -0.44 0.70 0.00 0.00 175.22 176.95 1dxd h ASP 44 N 8.73 0.30 1.56 1.36 3.32 -1.85 0.12 116.42 129.96 1dxd h ASP 44 Ca -0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1dxd h ASP 44 Cb 1.08 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.57 1dxd h ASP 44 CO 1.00 0.19 -0.17 0.03 -1.72 0.00 0.00 179.24 178.57 1dxd h ARG 45 N 0.34 0.00 0.00 3.56 3.08 -1.95 -3.37 114.38 116.04 1dxd h ARG 45 Ca 0.22 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1dxd h ARG 45 Cb 0.42 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1dxd h ARG 45 CO -0.05 0.00 0.00 1.19 -1.07 0.00 0.00 179.97 180.04 1dxd n PHE 46 N -2.61 0.00 0.40 3.04 3.72 -0.61 -4.76 117.46 116.64 1dxd n PHE 46 Ca 0.04 0.00 0.10 0.00 -0.05 0.00 0.00 57.45 57.55 1dxd n PHE 46 Cb 0.48 0.00 0.45 0.00 -0.94 0.00 0.00 39.48 39.47 1dxd n PHE 46 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1dxd n LYS 47 N -0.23 0.14 0.10 -1.08 2.85 -0.07 -1.39 118.16 118.47 1dxd n LYS 47 Ca 0.00 0.40 0.13 0.00 -1.05 0.00 0.00 58.31 57.79 1dxd n LYS 47 Cb 0.02 -1.79 0.43 0.00 -0.65 0.00 0.00 35.03 33.04 1dxd n LYS 47 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 177.40 174.96 1dxd n HIS 48 N -2.06 0.83 -1.98 5.58 1.44 -1.26 -4.87 115.22 112.90 1dxd n HIS 48 Ca 0.02 0.25 -0.42 0.00 -2.01 0.00 0.00 57.72 55.56 1dxd n HIS 48 Cb 0.20 -0.91 -0.03 0.00 0.12 0.00 0.00 29.99 29.37 1dxd n HIS 48 CO 0.00 0.00 0.00 -0.51 -2.81 0.00 0.00 176.34 173.02 1dxd s LEU 49 N -4.38 4.37 -0.11 2.39 1.43 -0.49 -4.91 118.68 116.99 1dxd s LEU 49 Ca 0.10 2.57 0.18 0.00 -1.03 0.00 0.00 54.13 55.95 1dxd s LEU 49 Cb 0.13 -3.59 -0.26 0.00 0.03 0.00 0.00 46.19 42.49 1dxd s LEU 49 CO 0.57 -0.79 0.24 0.29 0.23 0.00 0.00 176.35 176.89 1dxd n LYS 50 N 3.84 0.83 -4.20 1.70 5.02 -1.26 -5.00 118.16 119.09 1dxd n LYS 50 Ca 0.13 -0.09 -0.12 0.00 -2.02 0.00 0.00 58.31 56.21 1dxd n LYS 50 Cb 0.39 -1.46 -0.10 0.00 -0.02 0.00 0.00 35.03 33.84 1dxd n LYS 50 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1dxd s THR 51 N -2.87 0.41 0.31 -0.18 -4.23 -1.26 -5.04 115.64 102.78 1dxd s THR 51 Ca -0.08 -1.94 -0.00 0.00 -1.18 0.00 0.00 61.69 58.49 1dxd s THR 51 Cb 0.09 -2.06 0.22 0.00 1.34 0.00 0.00 72.50 72.08 1dxd s THR 51 CO 0.77 -0.49 1.93 -0.08 -0.54 0.00 0.00 174.62 176.21 1dxd h GLU 52 N 2.78 0.88 -0.65 3.99 4.81 -1.99 -1.48 114.58 122.93 1dxd h GLU 52 Ca -0.36 -0.10 0.04 0.00 -0.13 0.00 0.00 59.36 58.80 1dxd h GLU 52 Cb 1.20 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 30.36 1dxd h GLU 52 CO 0.61 0.67 0.39 0.00 -0.73 0.00 0.00 179.01 179.95 1dxd h ALA 53 N 1.47 0.85 -0.59 2.92 0.00 -1.99 0.45 119.26 122.37 1dxd h ALA 53 Ca 0.22 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 1dxd h ALA 53 Cb 0.06 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1dxd h ALA 53 CO -0.03 0.13 0.01 0.93 0.00 0.00 0.00 179.25 180.29 1dxd h GLU 54 N 0.76 1.03 -0.61 0.00 5.08 -1.84 -1.55 114.58 117.45 1dxd h GLU 54 Ca 0.27 -0.31 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1dxd h GLU 54 Cb 0.06 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1dxd h GLU 54 CO -0.12 1.00 0.23 0.52 -1.00 0.00 0.00 179.01 179.63 1dxd h MET 55 N 0.94 0.92 -0.21 2.33 2.86 -0.65 -2.15 114.93 118.97 1dxd h MET 55 Ca 0.17 -0.18 -0.08 0.00 -2.06 0.00 0.00 59.70 57.56 1dxd h MET 55 Cb 0.53 -0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.03 1dxd h MET 55 CO 0.03 0.79 -0.21 -0.22 1.06 0.00 0.00 176.91 178.36 1dxd h LYS 56 N 0.86 0.37 0.00 1.72 1.63 -0.72 -2.72 116.57 117.71 1dxd h LYS 56 Ca 0.20 -0.12 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 1dxd h LYS 56 Cb 0.23 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.82 1dxd h LYS 56 CO -0.01 0.57 -0.09 0.00 -3.45 0.00 0.00 179.45 176.47 1dxd n ALA 57 N -2.48 2.52 -2.43 5.00 0.00 -0.60 -4.80 120.51 117.72 1dxd n ALA 57 Ca -0.00 -0.13 -0.42 0.00 0.00 0.00 0.00 53.44 52.88 1dxd n ALA 57 Cb 0.36 -1.41 -0.02 0.00 0.00 0.00 0.00 19.45 18.37 1dxd n ALA 57 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1dxd s SER 58 N -3.15 6.31 0.22 0.00 0.15 -0.83 -4.89 113.70 111.50 1dxd s SER 58 Ca 0.13 0.49 -0.07 0.00 0.70 0.00 0.00 55.95 57.20 1dxd s SER 58 Cb 0.18 -2.55 0.18 0.00 -1.71 0.00 0.00 66.02 62.13 1dxd s SER 58 CO 0.56 -1.52 1.75 -0.33 1.20 0.00 0.00 173.24 174.90 1dxd h GLU 59 N 10.53 1.10 -0.58 5.44 4.39 -1.88 -1.83 114.58 131.73 1dxd h GLU 59 Ca -0.26 -0.24 -0.09 0.00 0.34 0.00 0.00 59.36 59.10 1dxd h GLU 59 Cb 1.09 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 29.56 1dxd h GLU 59 CO 1.14 0.95 -0.00 -0.44 -1.16 0.00 0.00 179.01 179.50 1dxd h ASP 60 N 1.05 1.00 -0.57 1.42 3.32 -1.97 -1.17 116.42 119.49 1dxd h ASP 60 Ca 0.22 -0.28 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 1dxd h ASP 60 Cb 0.33 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 1dxd h ASP 60 CO -0.00 1.05 0.04 0.25 -1.72 0.00 0.00 179.24 178.86 1dxd h LEU 61 N 0.93 0.95 -0.28 1.55 5.85 -1.84 -0.93 115.31 121.56 1dxd h LEU 61 Ca 0.17 -0.29 0.04 0.00 0.84 0.00 0.00 57.88 58.64 1dxd h LEU 61 Cb 0.54 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.28 1dxd h LEU 61 CO 0.03 1.00 0.04 0.50 -0.34 0.00 0.00 178.44 179.67 1dxd h LYS 62 N 0.87 0.13 -0.71 1.25 3.64 -1.04 -0.61 116.57 120.10 1dxd h LYS 62 Ca 0.17 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1dxd h LYS 62 Cb 0.49 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 1dxd h LYS 62 CO 0.02 0.08 0.44 0.87 -2.27 0.00 0.00 179.45 178.60 1dxd h LYS 63 N 0.13 0.95 -0.41 1.90 1.57 -0.99 -2.00 116.57 117.72 1dxd h LYS 63 Ca 0.13 -0.08 0.02 0.00 -1.87 0.00 0.00 60.65 58.85 1dxd h LYS 63 Cb 0.15 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.23 1dxd h LYS 63 CO -0.19 0.66 0.24 0.37 -0.57 0.00 0.00 179.45 179.96 1dxd h GLN 64 N 0.96 0.47 0.00 3.15 5.75 -0.67 -1.70 115.11 123.08 1dxd h GLN 64 Ca 0.26 -0.03 -0.07 0.00 -0.15 0.00 0.00 58.65 58.66 1dxd h GLN 64 Cb -0.06 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.37 1dxd h GLN 64 CO -0.05 0.31 -0.33 0.78 -2.65 0.00 0.00 178.83 176.89 1dxd h GLY 65 N 0.49 0.00 0.96 2.39 0.00 -0.72 -0.65 103.07 105.54 1dxd h GLY 65 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.43 1dxd h GLY 65 CO -0.07 0.00 0.05 -2.08 0.00 0.00 0.00 176.54 174.44 1dxd h VAL 66 N 0.00 1.25 -0.17 4.60 2.07 -0.98 -1.12 116.25 121.90 1dxd h VAL 66 Ca -0.00 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.58 1dxd h VAL 66 Cb 0.65 1.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1dxd h VAL 66 CO 0.04 0.32 0.08 -0.09 0.02 0.00 0.00 177.57 177.94 1dxd h ARG 67 N 0.58 0.24 0.17 1.57 2.43 -0.74 -0.93 114.38 117.71 1dxd h ARG 67 Ca 0.13 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.25 1dxd h ARG 67 Cb 0.41 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.92 1dxd h ARG 67 CO 0.01 0.30 -0.08 0.28 -1.51 0.00 0.00 179.97 178.96 1dxd h VAL 68 N 0.13 0.83 -0.20 0.20 2.07 -1.02 -1.62 116.25 116.64 1dxd h VAL 68 Ca 0.06 -0.01 -0.12 0.00 0.82 0.00 0.00 66.70 67.44 1dxd h VAL 68 Cb 0.14 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1dxd h VAL 68 CO -0.01 0.00 -0.40 -0.07 0.02 0.00 0.00 177.57 177.11 1dxd h LEU 69 N -0.24 0.48 -0.47 2.57 3.38 -1.19 -1.26 115.31 118.58 1dxd h LEU 69 Ca -0.02 -0.21 -0.10 0.00 0.09 0.00 0.00 57.88 57.64 1dxd h LEU 69 Cb 0.18 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.79 1dxd h LEU 69 CO 0.04 0.83 -0.08 0.74 0.09 0.00 0.00 178.44 180.06 1dxd h THR 70 N 0.38 1.27 -0.76 0.22 2.02 -1.12 0.20 112.91 115.12 1dxd h THR 70 Ca 0.03 -1.19 -0.00 0.00 0.77 0.00 0.00 66.41 66.02 1dxd h THR 70 Cb 0.87 1.07 -0.04 0.00 -1.74 0.00 0.00 68.15 68.32 1dxd h THR 70 CO 0.07 0.41 0.46 0.00 0.37 0.00 0.00 175.52 176.84 1dxd h ALA 71 N 0.89 0.96 -0.38 6.16 0.00 -1.03 -1.10 119.26 124.77 1dxd h ALA 71 Ca 0.12 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 1dxd h ALA 71 Cb 0.62 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 18.09 1dxd h ALA 71 CO 0.04 0.42 0.12 1.25 0.00 0.00 0.00 179.25 181.09 1dxd h LEU 72 N 1.03 0.56 -1.09 0.00 5.85 -1.01 -2.38 115.31 118.26 1dxd h LEU 72 Ca 0.27 -0.20 0.06 0.00 0.84 0.00 0.00 57.88 58.85 1dxd h LEU 72 Cb -0.05 -0.15 -0.06 0.00 0.37 0.00 0.00 40.66 40.77 1dxd h LEU 72 CO -0.05 0.61 0.61 1.23 -0.34 0.00 0.00 178.44 180.50 1dxd h GLY 73 N 0.47 1.40 1.11 3.75 0.00 -0.29 0.61 103.07 110.11 1dxd h GLY 73 Ca 0.12 -0.45 -0.07 0.00 0.00 0.00 0.00 47.33 46.94 1dxd h GLY 73 CO -0.00 0.33 0.17 0.00 0.00 0.00 0.00 176.54 177.04 1dxd h ALA 74 N 1.48 0.98 0.16 3.60 0.00 -0.96 -0.87 119.26 123.65 1dxd h ALA 74 Ca 0.40 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1dxd h ALA 74 Cb 0.15 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.67 1dxd h ALA 74 CO -0.15 0.66 -0.08 0.82 0.00 0.00 0.00 179.25 180.50 1dxd h ILE 75 N 1.05 0.87 -0.47 0.00 2.04 -0.83 -2.95 117.51 117.20 1dxd h ILE 75 Ca 0.22 -0.10 -0.03 0.00 1.00 0.00 0.00 64.86 65.95 1dxd h ILE 75 Cb 0.37 0.93 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 1dxd h ILE 75 CO 0.00 0.02 0.15 -0.07 0.00 0.00 0.00 178.15 178.25 1dxd h LEU 76 N -0.26 0.64 -1.84 1.44 3.38 -0.61 -1.81 115.31 116.25 1dxd h LEU 76 Ca -0.02 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1dxd h LEU 76 Cb 0.20 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1dxd h LEU 76 CO 0.04 0.61 0.00 0.11 0.09 0.00 0.00 178.44 179.29 1dxd h LYS 77 N 0.68 0.00 0.00 1.13 1.57 -1.05 -0.81 116.57 118.09 1dxd h LYS 77 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1dxd h LYS 77 Cb 0.20 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.51 1dxd h LYS 77 CO -0.01 0.00 0.00 1.63 -0.57 0.00 0.00 179.45 180.50 1dxd n LYS 78 N -2.95 0.21 -3.74 3.15 4.76 -0.68 -4.94 118.16 113.97 1dxd n LYS 78 Ca -0.00 0.28 -0.23 0.00 -2.87 0.00 0.00 58.31 55.49 1dxd n LYS 78 Cb 0.21 -1.80 0.02 0.00 -1.84 0.00 0.00 35.03 31.63 1dxd n LYS 78 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1dxd n LYS 79 N -2.17 -3.96 0.00 1.97 5.02 -0.31 -1.26 118.16 117.45 1dxd n LYS 79 Ca 0.04 0.56 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 1dxd n LYS 79 Cb 0.34 -4.92 0.00 0.00 -0.02 0.00 0.00 35.03 30.43 1dxd n LYS 79 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1dxd n GLY 80 N -1.67 2.21 2.56 0.72 0.00 -1.26 -4.94 105.19 102.81 1dxd n GLY 80 Ca -0.27 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.37 1dxd n GLY 80 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1dxd n HIS 81 N -2.00 2.50 -0.98 1.61 8.25 -0.38 -4.65 115.22 119.56 1dxd n HIS 81 Ca 0.00 -2.56 0.08 0.00 -0.26 0.00 0.00 57.72 54.98 1dxd n HIS 81 Cb 0.00 -1.53 0.31 0.00 1.12 0.00 0.00 29.99 29.89 1dxd n HIS 81 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1dxd n HIS 82 N 0.92 1.37 -0.12 4.41 1.44 -1.26 -4.72 115.22 117.26 1dxd n HIS 82 Ca 0.55 -0.85 -0.06 0.00 -2.01 0.00 0.00 57.72 55.36 1dxd n HIS 82 Cb 0.30 -0.40 0.02 0.00 0.12 0.00 0.00 29.99 30.04 1dxd n HIS 82 CO 0.00 0.00 0.00 1.49 -2.81 0.00 0.00 176.34 175.02 1dxd h GLU 83 N 2.56 0.29 -0.80 -1.40 4.57 -2.00 -1.16 114.58 116.64 1dxd h GLU 83 Ca 0.01 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.14 1dxd h GLU 83 Cb 1.66 -0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 30.15 1dxd h GLU 83 CO 0.33 0.19 0.36 0.00 -1.18 0.00 0.00 179.01 178.71 1dxd h ALA 84 N 1.25 1.04 -0.12 2.92 0.00 -2.00 -2.77 119.26 119.57 1dxd h ALA 84 Ca 0.18 -0.18 -0.14 0.00 0.00 0.00 0.00 54.91 54.77 1dxd h ALA 84 Cb 0.15 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1dxd h ALA 84 CO -0.18 0.63 -0.53 0.93 0.00 0.00 0.00 179.25 180.11 1dxd h GLU 85 N 1.15 0.33 0.00 0.00 3.07 -1.78 -3.20 114.58 114.15 1dxd h GLU 85 Ca 0.27 -0.20 -0.09 0.00 -0.50 0.00 0.00 59.36 58.84 1dxd h GLU 85 Cb 0.16 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.08 1dxd h GLU 85 CO -0.03 0.78 -0.44 -0.07 -1.40 0.00 0.00 179.01 177.85 1dxd h LEU 86 N 0.26 0.00 0.31 1.33 4.07 -1.04 -3.31 115.31 116.93 1dxd h LEU 86 Ca 0.01 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.96 1dxd h LEU 86 Cb 1.01 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 42.75 1dxd h LEU 86 CO 0.09 0.44 -0.18 0.11 -1.08 0.00 0.00 178.44 177.81 1dxd h LYS 87 N 0.00 -0.45 -0.16 1.13 1.57 -1.48 0.11 116.57 117.28 1dxd h LYS 87 Ca -0.00 0.03 -0.12 0.00 -1.87 0.00 0.00 60.65 58.69 1dxd h LYS 87 Cb 1.00 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 1dxd h LYS 87 CO 0.06 -0.30 -0.41 -1.00 -0.57 0.00 0.00 179.45 177.22 1dxd h PRO 88 N -0.47 0.37 -0.13 3.15 0.13 -1.75 -1.37 132.00 131.93 1dxd h PRO 88 Ca -0.03 -0.18 -0.04 0.00 -0.87 0.00 0.00 66.00 64.88 1dxd h PRO 88 Cb 0.39 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.51 1dxd h PRO 88 CO 0.04 0.72 -0.07 1.25 -0.23 0.00 0.00 178.00 179.71 1dxd h LEU 89 N 0.31 0.29 -0.36 1.56 5.85 -1.62 -1.36 115.31 119.98 1dxd h LEU 89 Ca 0.03 -0.42 0.04 0.00 0.84 0.00 0.00 57.88 58.36 1dxd h LEU 89 Cb 0.86 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 1dxd h LEU 89 CO 0.07 0.65 0.14 0.00 -0.34 0.00 0.00 178.44 178.96 1dxd h ALA 90 N 0.65 0.43 -0.18 1.25 0.00 -0.71 -0.68 119.26 120.01 1dxd h ALA 90 Ca 0.03 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1dxd h ALA 90 Cb 0.54 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1dxd h ALA 90 CO 0.02 -0.24 0.12 0.37 0.00 0.00 0.00 179.25 179.52 1dxd h GLN 91 N 0.31 0.23 -0.52 0.00 4.15 -1.05 0.11 115.11 118.34 1dxd h GLN 91 Ca 0.16 -0.01 -0.09 0.00 0.77 0.00 0.00 58.65 59.47 1dxd h GLN 91 Cb 0.11 -0.05 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 1dxd h GLN 91 CO -0.15 0.15 -0.04 0.66 -1.93 0.00 0.00 178.83 177.53 1dxd h SER 92 N 0.24 0.94 0.52 -0.69 4.64 -1.13 -1.50 113.55 116.58 1dxd h SER 92 Ca 0.07 -0.32 -0.16 0.00 -0.47 0.00 0.00 61.79 60.91 1dxd h SER 92 Cb -0.02 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.80 1dxd h SER 92 CO -0.02 1.04 -0.69 0.45 -0.87 0.00 0.00 176.83 176.74 1dxd h HIS 93 N 0.82 0.20 -0.02 4.77 3.86 -0.98 0.86 115.15 124.66 1dxd h HIS 93 Ca 0.14 -0.09 -0.11 0.00 -1.16 0.00 0.00 60.37 59.16 1dxd h HIS 93 Cb 0.58 -0.03 0.01 0.00 1.06 0.00 0.00 27.41 29.03 1dxd h HIS 93 CO 0.04 0.79 -0.41 0.00 0.86 0.00 0.00 177.93 179.22 1dxd h ALA 94 N 1.19 0.07 0.00 2.45 0.00 -0.75 0.24 119.26 122.47 1dxd h ALA 94 Ca -0.02 -0.50 -0.38 0.00 0.00 0.00 0.00 54.91 54.01 1dxd h ALA 94 Cb 1.23 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.97 1dxd h ALA 94 CO 0.10 0.22 -2.43 2.41 0.00 0.00 0.00 179.25 179.55 1dxd n THR 95 N -4.37 1.47 -0.10 0.00 -1.04 -0.57 -3.94 114.28 105.73 1dxd n THR 95 Ca -0.10 -0.65 -0.17 0.00 -2.04 0.00 0.00 64.05 61.09 1dxd n THR 95 Cb 0.57 -1.17 -0.07 0.00 -1.82 0.00 0.00 70.33 67.84 1dxd n THR 95 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1dxd n LYS 96 N -3.13 0.53 0.06 -2.82 4.81 -0.23 -4.64 118.16 112.74 1dxd n LYS 96 Ca -0.42 0.41 -0.04 0.00 -0.87 0.00 0.00 58.31 57.39 1dxd n LYS 96 Cb 1.04 -1.60 -0.08 0.00 0.02 0.00 0.00 35.03 34.40 1dxd n LYS 96 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1dxd h HIS 97 N -1.00 0.00 -5.37 5.64 -0.00 -1.06 -3.49 115.15 109.87 1dxd h HIS 97 Ca -0.27 0.00 -0.18 0.00 -0.00 0.00 0.00 60.37 59.92 1dxd h HIS 97 Cb 1.11 0.00 0.14 0.00 -0.00 0.00 0.00 27.41 28.66 1dxd h HIS 97 CO -0.14 0.81 -0.61 1.63 -0.00 0.00 0.00 177.93 179.63 1dxd n LYS 98 N -3.19 -1.94 -3.51 2.45 4.76 -0.11 -4.99 118.16 111.62 1dxd n LYS 98 Ca -0.04 1.02 -0.42 0.00 -2.87 0.00 0.00 58.31 56.00 1dxd n LYS 98 Cb 0.90 -5.72 -0.10 0.00 -1.84 0.00 0.00 35.03 28.27 1dxd n LYS 98 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1dxd s ILE 99 N -3.27 4.93 0.78 -0.18 -1.09 -0.16 -5.03 121.20 117.18 1dxd s ILE 99 Ca 0.32 -0.83 -0.12 0.00 -2.23 0.00 0.00 60.65 57.79 1dxd s ILE 99 Cb -0.04 -3.79 0.07 0.00 -1.58 0.00 0.00 42.46 37.12 1dxd s ILE 99 CO 0.73 -0.32 1.14 -2.84 -1.23 0.00 0.00 174.94 172.41 1dxd s PRO 100 N 1.61 1.99 0.32 2.79 0.02 -1.26 -4.82 135.00 135.64 1dxd s PRO 100 Ca 0.04 1.47 0.04 0.00 0.02 0.00 0.00 61.00 62.56 1dxd s PRO 100 Cb -0.20 -1.84 0.64 0.00 0.02 0.00 0.00 34.50 33.12 1dxd s PRO 100 CO 0.08 -1.89 1.88 0.82 -0.33 0.00 0.00 177.00 177.56 1dxd h ILE 101 N -0.91 0.95 -0.26 2.83 1.08 -1.93 0.02 117.51 119.30 1dxd h ILE 101 Ca -0.45 -0.31 0.00 0.00 -0.39 0.00 0.00 64.86 63.71 1dxd h ILE 101 Cb 1.26 -0.02 -0.01 0.00 -3.07 0.00 0.00 36.82 34.97 1dxd h ILE 101 CO 0.49 0.16 0.17 0.50 -0.69 0.00 0.00 178.15 178.78 1dxd h LYS 102 N 0.90 0.35 -0.03 2.37 3.64 -1.93 0.28 116.57 122.15 1dxd h LYS 102 Ca 0.43 -0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 59.60 1dxd h LYS 102 Cb 0.44 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.18 1dxd h LYS 102 CO -0.19 0.23 -0.81 1.88 -2.27 0.00 0.00 179.45 178.29 1dxd h TYR 103 N 0.36 0.41 -0.29 1.91 -1.99 -1.34 -1.51 116.97 114.52 1dxd h TYR 103 Ca 0.10 -0.20 -0.05 0.00 2.00 0.00 0.00 58.73 60.57 1dxd h TYR 103 Cb -0.03 -0.05 -0.02 0.00 2.00 0.00 0.00 36.73 38.63 1dxd h TYR 103 CO 0.00 0.98 -0.03 -0.07 -0.00 0.00 0.00 178.16 179.04 1dxd h LEU 104 N 0.18 0.42 -0.46 3.88 3.38 -0.86 -1.25 115.31 120.59 1dxd h LEU 104 Ca -0.04 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.81 1dxd h LEU 104 Cb 1.41 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 42.03 1dxd h LEU 104 CO 0.13 0.51 0.12 -0.33 0.09 0.00 0.00 178.44 178.96 1dxd h GLU 105 N 0.43 0.74 -0.60 1.13 5.08 -0.76 -1.53 114.58 119.06 1dxd h GLU 105 Ca 0.09 -0.17 0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1dxd h GLU 105 Cb 0.33 -0.10 -0.03 0.00 0.50 0.00 0.00 28.75 29.45 1dxd h GLU 105 CO 0.01 0.72 0.40 0.74 -1.00 0.00 0.00 179.01 179.89 1dxd h PHE 106 N 0.62 0.76 -0.22 4.33 0.04 -0.83 -0.98 116.94 120.65 1dxd h PHE 106 Ca 0.15 0.02 -0.09 0.00 2.80 0.00 0.00 57.97 60.85 1dxd h PHE 106 Cb 0.31 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 38.19 1dxd h PHE 106 CO 0.02 0.48 -0.24 0.97 -0.60 0.00 0.00 178.31 178.94 1dxd h ILE 107 N 0.82 1.25 -0.40 -0.55 2.10 -1.15 -1.23 117.51 118.35 1dxd h ILE 107 Ca 0.22 -1.20 -0.00 0.00 1.08 0.00 0.00 64.86 64.96 1dxd h ILE 107 Cb -0.09 1.35 -0.02 0.00 -1.09 0.00 0.00 36.82 36.96 1dxd h ILE 107 CO -0.05 0.38 0.25 0.28 -1.08 0.00 0.00 178.15 177.93 1dxd h SER 108 N 0.37 0.47 -0.83 2.19 0.02 -0.75 -0.13 113.55 114.88 1dxd h SER 108 Ca 0.06 -0.04 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1dxd h SER 108 Cb 0.62 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 63.00 1dxd h SER 108 CO 0.04 0.37 0.55 -0.33 -1.14 0.00 0.00 176.83 176.32 1dxd h GLU 109 N 0.53 1.08 -0.56 3.45 5.08 -0.83 -1.01 114.58 122.33 1dxd h GLU 109 Ca 0.14 -0.07 -0.08 0.00 -1.00 0.00 0.00 59.36 58.36 1dxd h GLU 109 Cb -0.02 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 28.96 1dxd h GLU 109 CO -0.03 0.72 0.05 0.00 -1.00 0.00 0.00 179.01 178.75 1dxd h ALA 110 N 1.31 0.74 -0.03 3.43 0.00 -0.68 0.02 119.26 124.05 1dxd h ALA 110 Ca 0.31 -0.27 0.02 0.00 0.00 0.00 0.00 54.91 54.97 1dxd h ALA 110 Cb -0.11 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1dxd h ALA 110 CO -0.08 0.52 -0.08 0.82 0.00 0.00 0.00 179.25 180.44 1dxd h ILE 111 N 0.84 0.78 -0.45 0.00 2.04 -0.79 -1.26 117.51 118.67 1dxd h ILE 111 Ca 0.16 0.00 0.04 0.00 1.00 0.00 0.00 64.86 66.07 1dxd h ILE 111 Cb 0.47 0.78 -0.04 0.00 -0.74 0.00 0.00 36.82 37.29 1dxd h ILE 111 CO 0.02 0.00 0.21 0.40 0.00 0.00 0.00 178.15 178.78 1dxd h ILE 112 N -0.13 0.95 -0.55 -0.67 2.04 -0.99 -0.77 117.51 117.39 1dxd h ILE 112 Ca 0.04 -0.15 0.03 0.00 1.00 0.00 0.00 64.86 65.78 1dxd h ILE 112 Cb 0.18 0.48 -0.04 0.00 -0.74 0.00 0.00 36.82 36.71 1dxd h ILE 112 CO -0.11 0.08 0.33 -0.74 0.00 0.00 0.00 178.15 177.71 1dxd h HIS 113 N 0.42 0.63 -0.42 1.37 2.76 -0.71 -0.29 115.15 118.91 1dxd h HIS 113 Ca 0.20 0.02 -0.09 0.00 -2.20 0.00 0.00 60.37 58.29 1dxd h HIS 113 Cb 0.12 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 28.87 1dxd h HIS 113 CO -0.11 0.36 -0.10 0.28 -1.30 0.00 0.00 177.93 177.06 1dxd h VAL 114 N 0.66 1.27 -0.56 5.26 2.07 -0.91 -1.29 116.25 122.75 1dxd h VAL 114 Ca 0.22 -1.20 -0.07 0.00 0.82 0.00 0.00 66.70 66.48 1dxd h VAL 114 Cb 0.02 1.19 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 1dxd h VAL 114 CO -0.10 0.40 0.08 -0.07 0.02 0.00 0.00 177.57 177.90 1dxd h LEU 115 N 0.62 0.87 -0.92 2.57 3.38 -1.03 0.54 115.31 121.34 1dxd h LEU 115 Ca 0.11 -0.19 -0.00 0.00 0.09 0.00 0.00 57.88 57.88 1dxd h LEU 115 Cb 0.63 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.10 1dxd h LEU 115 CO 0.04 0.88 0.56 -0.74 0.09 0.00 0.00 178.44 179.27 1dxd h HIS 116 N 0.86 1.21 -0.00 1.13 2.76 -0.80 0.49 115.15 120.81 1dxd h HIS 116 Ca 0.17 -0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 58.20 1dxd h HIS 116 Cb 0.40 -0.40 0.01 0.00 1.55 0.00 0.00 27.41 28.97 1dxd h HIS 116 CO 0.02 0.80 -0.56 1.03 -1.30 0.00 0.00 177.93 177.93 1dxd h SER 117 N 1.27 0.49 0.53 3.26 0.87 -0.87 -3.35 113.55 115.75 1dxd h SER 117 Ca 0.33 -0.76 -0.21 0.00 -1.23 0.00 0.00 61.79 59.91 1dxd h SER 117 Cb -0.06 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.75 1dxd h SER 117 CO -0.06 1.19 -0.94 0.03 -0.53 0.00 0.00 176.83 176.52 1dxd h ARG 118 N -0.15 0.26 -1.90 2.24 3.08 -0.85 -3.41 114.38 113.65 1dxd h ARG 118 Ca -0.07 -0.30 -0.55 0.00 0.07 0.00 0.00 59.98 59.13 1dxd h ARG 118 Cb 1.28 0.09 -0.41 0.00 0.08 0.00 0.00 29.97 31.01 1dxd h ARG 118 CO 0.11 1.03 -0.81 0.72 -1.07 0.00 0.00 179.97 179.95 1dxd n HIS 119 N -3.66 2.96 0.31 3.04 8.25 0.16 -4.87 115.22 121.40 1dxd n HIS 119 Ca -0.05 -3.60 0.19 0.00 -0.26 0.00 0.00 57.72 54.00 1dxd n HIS 119 Cb 0.85 -0.35 1.00 0.00 1.12 0.00 0.00 29.99 32.60 1dxd n HIS 119 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1dxd h PRO 120 N 2.87 0.00 0.00 -0.41 0.13 -1.75 0.16 132.00 133.01 1dxd h PRO 120 Ca 0.15 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.21 1dxd h PRO 120 Cb 0.76 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.88 1dxd h PRO 120 CO 0.74 0.02 -0.31 0.78 -0.23 0.00 0.00 178.00 179.01 1dxd h GLY 121 N 0.53 0.00 -0.17 1.56 0.00 -1.94 -3.23 103.07 99.83 1dxd h GLY 121 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1dxd h GLY 121 CO 0.00 0.00 -0.08 0.70 0.00 0.00 0.00 176.54 177.16 1dxd n ASN 122 N -3.75 1.32 -2.71 0.19 3.02 -0.36 -4.84 115.26 108.13 1dxd n ASN 122 Ca -0.01 -2.06 -0.06 0.00 -0.03 0.00 0.00 54.58 52.41 1dxd n ASN 122 Cb 0.41 -0.15 0.05 0.00 -0.61 0.00 0.00 39.78 39.48 1dxd n ASN 122 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1dxd n PHE 123 N -0.55 0.67 -0.75 3.10 7.35 0.41 -4.50 117.46 123.19 1dxd n PHE 123 Ca 0.04 -2.51 -0.14 0.00 -0.76 0.00 0.00 57.45 54.08 1dxd n PHE 123 Cb 0.48 -0.06 0.12 0.00 0.35 0.00 0.00 39.48 40.37 1dxd n PHE 123 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1dxd n GLY 124 N -0.30 -2.63 0.15 7.13 0.00 -1.25 -4.58 105.19 103.71 1dxd n GLY 124 Ca 0.06 -1.47 -0.07 0.00 0.00 0.00 0.00 46.02 44.55 1dxd n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dxd h ALA 125 N -2.36 0.40 -0.45 4.61 0.00 -1.98 0.04 119.26 119.51 1dxd h ALA 125 Ca -0.20 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1dxd h ALA 125 Cb 0.60 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1dxd h ALA 125 CO 0.13 -0.24 0.16 -0.44 0.00 0.00 0.00 179.25 178.85 1dxd h ASP 126 N 0.31 0.65 -0.70 0.00 3.32 -1.99 -0.19 116.42 117.82 1dxd h ASP 126 Ca 0.15 -0.19 -0.06 0.00 0.02 0.00 0.00 57.03 56.95 1dxd h ASP 126 Cb 0.09 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1dxd h ASP 126 CO -0.13 0.66 0.21 0.00 -1.72 0.00 0.00 179.24 178.26 1dxd h ALA 127 N 1.01 1.03 -0.61 3.45 0.00 -1.79 -1.25 119.26 121.10 1dxd h ALA 127 Ca 0.15 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.78 1dxd h ALA 127 Cb 0.24 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1dxd h ALA 127 CO -0.01 0.65 0.17 0.37 0.00 0.00 0.00 179.25 180.43 1dxd h GLN 128 N 1.06 0.96 -0.71 0.00 4.15 -0.73 -1.02 115.11 118.81 1dxd h GLN 128 Ca 0.23 -0.22 0.03 0.00 0.77 0.00 0.00 58.65 59.46 1dxd h GLN 128 Cb 0.31 -0.13 -0.05 0.00 0.21 0.00 0.00 27.48 27.83 1dxd h GLN 128 CO -0.01 0.86 0.45 0.78 -1.93 0.00 0.00 178.83 178.98 1dxd h GLY 129 N 0.87 1.03 0.88 2.39 0.00 -0.71 0.96 103.07 108.50 1dxd h GLY 129 Ca 0.19 -0.34 -0.02 0.00 0.00 0.00 0.00 47.33 47.17 1dxd h GLY 129 CO -0.00 0.28 0.07 0.00 0.00 0.00 0.00 176.54 176.89 1dxd h ALA 130 N 1.31 0.34 -0.63 3.60 0.00 -0.84 -0.47 119.26 122.57 1dxd h ALA 130 Ca 0.29 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.06 1dxd h ALA 130 Cb 0.03 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.68 1dxd h ALA 130 CO -0.11 -0.03 0.40 1.98 0.00 0.00 0.00 179.25 181.49 1dxd h MET 131 N 0.25 0.78 -0.62 0.00 -1.53 -0.95 -0.58 114.93 112.28 1dxd h MET 131 Ca 0.08 -0.05 0.03 0.00 -3.44 0.00 0.00 59.70 56.32 1dxd h MET 131 Cb 0.25 -0.18 -0.04 0.00 -0.55 0.00 0.00 31.60 31.09 1dxd h MET 131 CO -0.00 0.52 0.38 -0.97 0.14 0.00 0.00 176.91 176.98 1dxd h ASN 132 N 0.81 0.63 -0.69 1.39 -1.24 -0.57 -0.15 115.58 115.76 1dxd h ASN 132 Ca 0.24 0.00 0.05 0.00 0.71 0.00 0.00 56.30 57.30 1dxd h ASN 132 Cb -0.04 -0.13 -0.05 0.00 0.73 0.00 0.00 38.32 38.82 1dxd h ASN 132 CO -0.08 0.44 0.40 0.50 -1.29 0.00 0.00 177.43 177.41 1dxd h LYS 133 N 0.76 0.73 -0.52 6.67 3.64 -0.68 0.14 116.57 127.31 1dxd h LYS 133 Ca 0.25 -0.04 -0.08 0.00 -1.27 0.00 0.00 60.65 59.51 1dxd h LYS 133 Cb 0.01 -0.16 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 1dxd h LYS 133 CO -0.10 0.48 0.02 0.00 -2.27 0.00 0.00 179.45 177.58 1dxd h ALA 134 N 1.34 1.06 -0.11 5.00 0.00 -0.50 -1.16 119.26 124.89 1dxd h ALA 134 Ca 0.30 -0.27 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 1dxd h ALA 134 Cb 0.14 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1dxd h ALA 134 CO -0.16 0.59 -0.65 -0.07 0.00 0.00 0.00 179.25 178.96 1dxd h LEU 135 N 0.80 0.49 -0.76 0.00 3.38 -0.64 -1.25 115.31 117.33 1dxd h LEU 135 Ca 0.16 -0.30 -0.07 0.00 0.09 0.00 0.00 57.88 57.76 1dxd h LEU 135 Cb 0.46 -0.14 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 1dxd h LEU 135 CO 0.02 1.01 0.14 -0.33 0.09 0.00 0.00 178.44 179.37 1dxd h GLU 136 N 0.31 1.08 -0.09 1.13 5.08 -0.56 -0.49 114.58 121.02 1dxd h GLU 136 Ca -0.02 -0.26 -0.00 0.00 -1.00 0.00 0.00 59.36 58.08 1dxd h GLU 136 Cb 1.21 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 30.31 1dxd h GLU 136 CO 0.11 0.96 0.04 1.25 -1.00 0.00 0.00 179.01 180.38 1dxd h LEU 137 N 1.02 0.13 -0.39 1.33 5.85 -1.02 0.12 115.31 122.34 1dxd h LEU 137 Ca 0.21 -0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.87 1dxd h LEU 137 Cb 0.39 -0.03 -0.07 0.00 0.37 0.00 0.00 40.66 41.32 1dxd h LEU 137 CO 0.01 0.23 -0.06 0.15 -0.34 0.00 0.00 178.44 178.42 1dxd h PHE 138 N 0.02 -0.13 -0.33 1.25 3.57 -1.05 -0.36 116.94 119.90 1dxd h PHE 138 Ca 0.03 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.44 1dxd h PHE 138 Cb 0.14 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1dxd h PHE 138 CO -0.03 -0.13 -0.30 0.00 -2.23 0.00 0.00 178.31 175.62 1dxd h ARG 139 N 0.04 0.71 -0.27 1.11 3.08 -0.86 0.26 114.38 118.45 1dxd h ARG 139 Ca 0.19 -0.32 0.02 0.00 0.07 0.00 0.00 59.98 59.94 1dxd h ARG 139 Cb 0.28 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.30 1dxd h ARG 139 CO -0.37 0.92 0.13 -0.22 -1.07 0.00 0.00 179.97 179.36 1dxd h LYS 140 N 0.60 0.27 -0.24 0.04 3.64 -0.37 0.08 116.57 120.59 1dxd h LYS 140 Ca 0.07 -0.02 -0.17 0.00 -1.27 0.00 0.00 60.65 59.27 1dxd h LYS 140 Cb 0.81 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.56 1dxd h LYS 140 CO 0.07 0.18 -0.53 -0.44 -2.27 0.00 0.00 179.45 176.46 1dxd h ASP 141 N 0.28 0.78 -0.62 4.20 3.32 -0.84 -1.83 116.42 121.71 1dxd h ASP 141 Ca 0.11 -0.41 -0.01 0.00 0.02 0.00 0.00 57.03 56.74 1dxd h ASP 141 Cb 0.03 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.33 1dxd h ASP 141 CO -0.07 1.16 0.33 0.40 -1.72 0.00 0.00 179.24 179.34 1dxd h ILE 142 N 0.54 1.20 -0.41 0.35 1.08 -0.90 -1.89 117.51 117.50 1dxd h ILE 142 Ca 0.02 -0.52 -0.03 0.00 -0.39 0.00 0.00 64.86 63.93 1dxd h ILE 142 Cb 1.10 0.42 -0.02 0.00 -3.07 0.00 0.00 36.82 35.25 1dxd h ILE 142 CO 0.11 0.22 0.14 0.00 -0.69 0.00 0.00 178.15 177.93 1dxd h ALA 143 N 1.15 1.48 -0.55 1.87 0.00 -0.72 0.18 119.26 122.66 1dxd h ALA 143 Ca 0.22 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1dxd h ALA 143 Cb 0.06 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 1dxd h ALA 143 CO -0.03 0.40 0.00 0.00 0.00 0.00 0.00 179.25 179.62 1dxd h ALA 144 N 1.57 0.75 -0.49 0.00 0.00 -1.01 -1.87 119.26 118.20 1dxd h ALA 144 Ca 0.14 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.68 1dxd h ALA 144 Cb 0.16 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1dxd h ALA 144 CO -0.01 0.57 0.03 -0.22 0.00 0.00 0.00 179.25 179.62 1dxd h LYS 145 N 0.86 0.85 -0.50 0.00 1.63 -0.62 -2.31 116.57 116.48 1dxd h LYS 145 Ca 0.16 -0.25 0.10 0.00 -0.85 0.00 0.00 60.65 59.80 1dxd h LYS 145 Cb 0.53 -0.09 -0.09 0.00 -0.60 0.00 0.00 32.23 31.99 1dxd h LYS 145 CO 0.03 0.87 -0.06 1.88 -3.45 0.00 0.00 179.45 178.71 1dxd h TYR 146 N 0.71 -0.15 -0.82 1.91 -1.99 -0.43 -0.37 116.97 115.84 1dxd h TYR 146 Ca 0.14 0.04 -0.03 0.00 2.00 0.00 0.00 58.73 60.88 1dxd h TYR 146 Cb 0.47 0.14 -0.04 0.00 2.00 0.00 0.00 36.73 39.31 1dxd h TYR 146 CO 0.03 -0.17 0.39 0.87 -0.00 0.00 0.00 178.16 179.28 1dxd h LYS 147 N 0.05 1.17 -0.36 4.88 1.79 -1.10 -0.21 116.57 122.79 1dxd h LYS 147 Ca 0.25 -0.17 -0.03 0.00 -2.18 0.00 0.00 60.65 58.51 1dxd h LYS 147 Cb 0.38 -0.21 -0.02 0.00 -1.58 0.00 0.00 32.23 30.80 1dxd h LYS 147 CO -0.47 0.90 0.08 0.93 -1.08 0.00 0.00 179.45 179.81 1dxd h GLU 148 N 1.16 0.53 0.00 3.15 5.08 -0.76 -2.02 114.58 121.72 1dxd h GLU 148 Ca 0.28 -0.09 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1dxd h GLU 148 Cb 0.12 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1dxd h GLU 148 CO -0.03 0.50 0.00 1.28 -1.00 0.00 0.00 179.01 179.76 1dxd n LEU 149 N -4.33 0.15 0.00 1.33 4.77 -0.23 -4.92 117.00 113.76 1dxd n LEU 149 Ca 0.02 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.51 1dxd n LEU 149 Cb 0.19 -0.47 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 1dxd n LEU 149 CO 0.38 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 1dxd n GLY 150 N 1.41 0.75 3.50 -0.72 0.00 -0.63 -5.05 105.19 104.45 1dxd n GLY 150 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.74 1dxd n GLY 150 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1dxd s TYR 151 N -2.00 3.07 0.36 1.61 5.04 -0.19 -5.00 117.35 120.25 1dxd s TYR 151 Ca 0.00 -0.29 0.05 0.00 -2.44 0.00 0.00 57.07 54.40 1dxd s TYR 151 Cb 0.00 -2.03 0.73 0.00 0.35 0.00 0.00 41.96 41.01 1dxd s TYR 151 CO 0.00 -0.08 1.98 1.96 -1.34 0.00 0.00 175.55 178.07 1dxd h GLN 152 N 7.01 0.74 0.00 4.97 7.50 -1.94 -3.26 115.11 130.13 1dxd h GLN 152 Ca -0.34 -0.04 0.00 0.00 0.50 0.00 0.00 58.65 58.77 1dxd h GLN 152 Cb 1.18 -0.17 0.00 0.00 0.05 0.00 0.00 27.48 28.55 1dxd h GLN 152 CO 0.63 0.49 0.00 0.41 -1.50 0.00 0.00 178.83 178.86